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fixed signal handling in md_openmm
2010-05-12
Szilard Pall
fixed signal ha
n
d
ling in md_o
p
enmm
commit
|
commitdiff
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tree
2010-05-12
Szilard
Pa
l
l
M
e
rge b
r
anch 'm
a
ster'
o
f
g
i
t
@git
.
g
r
o
ma
c
s
.
org:
g
romacs
commit
|
commitdiff
|
tree
2010-05-12
Szilard
Pall
min
o
r fixes
i
n do
c
umen
t
ation + some d
e
bugging code
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
S
z
ilard
Pal
l
a
dded
os-specific
d
efines f
r
om
c
m
ake re
q
u
ired by memte
s
tG80
commit
|
commitdiff
|
tree
2010-05-10
Szilard Pall
MSVC fix for
g
mx_paralle
l
_3dfft
.
c
commit
|
commitdiff
|
tree
2010-05-10
Szilard Pall
only issue
o
pen
m
m constr
i
nts w
a
rning if
c
onst
r
ainsta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard
Pall
Merge bran
c
h 'master' o
f
g
it@git
.
g
romacs
.
org:gro
m
acs
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
lard Pall
t
empor
a
r
y f
i
x f
o
r
co
m
pila
t
ion
erro
r
with GMX_OPENMM=O
N
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard
P
all
M
erg
e
branch 'mas
t
er' of git@gi
t
.
gromac
s
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
Merge
b
ranch 'master' of git@g
i
t
.
g
romacs
.
org:gromac
s
commit
|
commitdiff
|
tree
2010-05-07
S
z
ilard Pall
add
e
d
gromacs file head
e
rs to the OpenMM-relat
e
d file
s
commit
|
commitdiff
|
tree
2010-05-07
Szilar
d
Pall
minor fixes,
d
o
c
u
mentation and slight API
c
hange in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard Pall
minor upd
a
tes
t
o Fi
n
dGit and FindOpenMM
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pal
l
updat
e
d FindCUDA to version
fro
m
cmak
e
2
.
8
.
1
f
or CUDA
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
Szilard Pall
M
er
g
e
branch
'master' of
g
i
t
@
g
i
t
.
gromacs
.
org
:
gromacs
commit
|
commitdiff
|
tree
2010-04-20
S
z
ilard Pall
doxygen
c
omments f
o
r the
O
penMM part
commit
|
commitdiff
|
tree
2010-04-16
Szil
a
rd Pall
added
d
ocumentation
f
o
r the
o
penmm_wrap
p
er
commit
|
commitdiff
|
tree
2010-04-16
S
zil
a
rd Pall
f
o
rmatting fix of openmm wra
p
per - grom
a
c
s
ified
th
e
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szi
l
a
rd Pal
l
cleaned
u
p a bun
c
h
op mess
i
n do
_
md_op
e
nmm
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pa
l
l
bugf
i
x
f
or do_md_openm
m
- was always pulling data from
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
S
zilard Pal
l
fixed
t
i
ming
b
ug in do_md_openmm
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pal
l
add
e
d
some more supported GPU
s
(high-end
mobi
l
e an
d
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Szilard
Pall
Merge branch 'master' of g
i
t@gi
t
.
groma
c
s
.
org:
g
ro
m
acs
commit
|
commitdiff
|
tree
2010-04-06
S
zila
r
d Pall
now g_ba
r
l
ook
s
for
lambda o
n
l
y
in the last direct
o
ry
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Sz
i
la
r
d Pall
F
ixed g_bar bug in la
m
bd
a
val
u
e
parsing f
r
om pat
h
.
commit
|
commitdiff
|
tree
2010-03-29
Szilard P
a
ll
fixed gmxGenerateVersionI
n
f
o
.
c
m
ake
to produce 8 digit
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szila
r
d Pall
The
c
make de
v
elopmen
t
infor
m
ation generating works
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilar
d
Pall
adde
d
FindG
i
t
.
cm
a
ke script
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
fi
x
for
g
m
x
GenerateVers
i
onInfo
.
cmak
e
, now works with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Szilard Pall
fix
e
d
USE
_
VERSI
O
N_H
C
m
ake optio
n
commit
|
commitdiff
|
tree
2010-03-18
Szilard Pall
M
erge branch 'mas
t
er' o
f
git@g
i
t
.
gr
o
macs
.
org:g
r
om
a
cs
commit
|
commitdiff
|
tree
2010-03-18
Sz
i
lard Pall
fixed t
h
e problem of version
.
c not being buil
t
at
the
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
Szi
l
a
rd
Pall
added mi
s
sing V
E
R
SION prefix to
_
gmx
_
ver_stri
n
g
commit
|
commitdiff
|
tree
2010-03-16
Szila
r
d Pall
f
i
x
for genversion
.
sh to recog
n
ize the
g
it:
/
/
.
.
.
/
gromac
s
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
S
z
i
l
a
rd Pall
Merge b
r
anch 'master' of
g
it@g
i
t
.
g
roma
c
s
.
org:gr
o
m
a
cs
commit
|
commitdiff
|
tree
2010-03-16
S
z
i
lard Pal
l
Cmak
e
impl
e
mentation to generate devel
o
pment build
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Sz
i
l
a
r
d
Pal
l
Ope
n
MM
b
uild n
o
t
dependent on ff
t
w an
y
more
commit
|
commitdiff
|
tree
2010-03-11
S
z
ilard Pall
fi
x
ed mdrun
v
er
b
osi
t
y wi
t
h OpenMM buil
d
commit
|
commitdiff
|
tree
2010-03-11
Szilar
d
Pall
fix
e
d
a
missin
g
comma and a typo in op
e
nm
m
_
w
ra
p
p
e
r
commit
|
commitdiff
|
tree
2010-03-11
S
z
ilard Pall
Delete src/kernel/do_md_ope
n
mm_nopatch
.
h, it's not
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szil
a
rd Pal
l
M
inor cleanup, some
rear
r
angaments, and
c
ommenting
.
commit
|
commitdiff
|
tree
2010-03-11
Szilar
d
Pall
Reverted stupid
change in CMaleLists
.
tx
t
commit
|
commitdiff
|
tree
2010-03-11
S
z
i
lard Pall
Ren
a
m
ed
m
d_open
m
m into open
m
m_wr
a
pper
,
and d
o
_md_op
e
nmm
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Szila
r
d Pall
Fixed deadl
o
ck occu
r
ing in
gm
x
_
f
a
tal
.
c: intr
o
duced
.
.
.
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|
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|
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